Compound Identification
SMILES
NCCCC[C@H](N(C(=O)OCC1=CC=CC=C1)C(=O)C1=CC2=C(O1)C=CC1=C2OC(=O)C=C1)C(O)=O
InChIKey
InChIKey=MKNBSRHIVVUEPA-IBGZPJMESA-N
Formula
C26H24N2O8
Mass
492.484
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Furanocoumarins
- Level 5 Angular furanocoumarins
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Subclass
Furanocoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Furanocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular furanocoumarins
Alternative Parents
N-acyl-alpha amino acids 1-benzopyrans Benzyloxycarbonyls Benzofurans Medium-chain fatty acids Furoic acid and derivatives Pyranones and derivatives Amino fatty acids Heterocyclic fatty acids Carbamate esters Heteroaromatic compounds Lactones Amino acids Carboxylic acids Oxacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Monoalkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular furanocoumarin - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 1-benzopyran - Benzopyran - Benzyloxycarbonyl - Benzofuran - Furoic acid or derivatives - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Pyranone - Benzenoid - Monocyclic benzene moiety - Pyran - Fatty acid - Fatty acyl - Furan - Heteroaromatic compound - Carbamic acid ester - Amino acid - Lactone - Amino acid or derivatives - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular furanocoumarins. These are furanocoumarins, with a structure characterized by a furan ring angularly fused to a coumarin.
External Descriptors
Not available